SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4iwn'

List of Similar Pattern of Amino Acids

Hit pattern: 3D amino acid arrangements similar to known drug binding site
Query pattern: Residues from known binding site for annotated drug that match the hit pattern

(Click on the DrReposER ID to view details on interfaces and similar patterns of amino acids)
(Click on the view link on the last column to view superposed patterns of amino acids)
Filter list by:
DrReposER ID / Desc. Hit
PDBID		 Hit
Macromolecule		 Res.
Matches		 Interface HETATM RMSD Dali
Z-score		 Seq.
Identity (%)		 View Dock
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1HSH_A_MK1A401_2
(HIV-II PROTEASE)		 4iwn TRNA
(CMO5U34)-METHYLTRAN
SFERASE
(Escherichia
coli) 		5 / 9 ALA A 126
ILE A 150
ILE A  85
ILE A 121
ILE A 123
 None
 0.97A 1hshB-4iwnA:
undetectable		 1hshB-4iwnA:
16.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1HSH_C_MK1C402_1
(HIV-II PROTEASE)		 4iwn TRNA
(CMO5U34)-METHYLTRAN
SFERASE
(Escherichia
coli) 		5 / 12 ALA A 126
ILE A 150
ILE A  85
ILE A 121
ILE A 123
 None
 0.89A 1hshC-4iwnA:
undetectable		 1hshC-4iwnA:
16.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1VQ1_A_SAMA301_1
(N5-GLUTAMINE
METHYLTRANSFERASE,
HEMK)		 4iwn TRNA
(CMO5U34)-METHYLTRAN
SFERASE
(Escherichia
coli) 		3 / 3 GLY A  64
ASP A  89
ASN A 132
 GEK  A 301 (-3.6A)
GEK  A 301 (-2.8A)
GEK  A 301 (-3.7A)
 0.59A 1vq1A-4iwnA:
12.4		 1vq1A-4iwnA:
22.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1YC5_A_NCAA2001_0
(NAD-DEPENDENT
DEACETYLASE)		 4iwn TRNA
(CMO5U34)-METHYLTRAN
SFERASE
(Escherichia
coli) 		4 / 7 ALA A  70
SER A  73
ASP A  62
ILE A  42
 GEK  A 301 ( 4.1A)
None
GEK  A 301 ( 4.5A)
None
 0.88A 1yc5A-4iwnA:
2.9		 1yc5A-4iwnA:
21.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2HYY_A_STIA600_2
(PROTO-ONCOGENE
TYROSINE-PROTEIN
KINASE ABL1)		 4iwn TRNA
(CMO5U34)-METHYLTRAN
SFERASE
(Escherichia
coli) 		5 / 6 LEU A 135
VAL A 111
VAL A 129
ILE A  88
ARG A  76
 None
 1.50A 2hyyA-4iwnA:
undetectable		 2hyyA-4iwnA:
20.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2Q72_A_IXXA801_1
(TRANSPORTER)		 4iwn TRNA
(CMO5U34)-METHYLTRAN
SFERASE
(Escherichia
coli) 		5 / 11 LEU A 131
LEU A 162
ILE A 150
ALA A 240
LEU A 154
 None
 1.14A 2q72A-4iwnA:
undetectable		 2q72A-4iwnA:
16.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2QB4_A_DSMA801_1
(TRANSPORTER)		 4iwn TRNA
(CMO5U34)-METHYLTRAN
SFERASE
(Escherichia
coli) 		5 / 12 LEU A 131
LEU A 162
ILE A 150
ALA A 240
LEU A 154
 None
 1.09A 2qb4A-4iwnA:
undetectable		 2qb4A-4iwnA:
16.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2QJU_A_DSMA801_1
(TRANSPORTER)		 4iwn TRNA
(CMO5U34)-METHYLTRAN
SFERASE
(Escherichia
coli) 		5 / 11 LEU A 131
LEU A 162
ILE A 150
ALA A 240
LEU A 154
 None
 1.13A 2qjuA-4iwnA:
undetectable		 2qjuA-4iwnA:
16.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3E4E_A_4PZA501_1
(CYTOCHROME P450 2E1)		 4iwn TRNA
(CMO5U34)-METHYLTRAN
SFERASE
(Escherichia
coli) 		3 / 3 ALA A  87
THR A  71
CYH A  98
 None
 0.79A 3e4eA-4iwnA:
undetectable		 3e4eA-4iwnA:
20.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3GWV_A_RFXA801_1
(TRANSPORTER)		 4iwn TRNA
(CMO5U34)-METHYLTRAN
SFERASE
(Escherichia
coli) 		5 / 12 LEU A 131
LEU A 162
ILE A 150
ALA A 240
LEU A 154
 None
 1.05A 3gwvA-4iwnA:
undetectable		 3gwvA-4iwnA:
16.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4IV8_A_SAMA301_0
(PHOSPHOETHANOLAMINE
N-METHYLTRANSFERASE,
PUTATIVE)		 4iwn TRNA
(CMO5U34)-METHYLTRAN
SFERASE
(Escherichia
coli) 		6 / 12 GLY A  64
ASP A  89
MET A  94
ASP A 117
ILE A 118
LEU A 138
 GEK  A 301 (-3.6A)
GEK  A 301 (-2.8A)
GEK  A 301 ( 4.1A)
GEK  A 301 (-3.2A)
GEK  A 301 (-3.7A)
None
 0.92A 4iv8A-4iwnA:
18.4		 4iv8A-4iwnA:
22.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4IV8_B_SAMB301_0
(PHOSPHOETHANOLAMINE
N-METHYLTRANSFERASE,
PUTATIVE)		 4iwn TRNA
(CMO5U34)-METHYLTRAN
SFERASE
(Escherichia
coli) 		6 / 12 GLY A  64
ASP A  89
MET A  94
ASP A 117
ILE A 118
LEU A 138
 GEK  A 301 (-3.6A)
GEK  A 301 (-2.8A)
GEK  A 301 ( 4.1A)
GEK  A 301 (-3.2A)
GEK  A 301 (-3.7A)
None
 0.96A 4iv8B-4iwnA:
18.3		 4iv8B-4iwnA:
22.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4OU1_A_BEZA302_0
(RETRO-ALDOLASE,
DESIGN RA114)		 4iwn TRNA
(CMO5U34)-METHYLTRAN
SFERASE
(Escherichia
coli) 		4 / 8 ILE A  43
ILE A  46
ASN A  77
ALA A  50
 None
 1.00A 4ou1A-4iwnA:
undetectable		 4ou1A-4iwnA:
22.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5DPD_B_SAMB601_0
(PROTEIN LYSINE
METHYLTRANSFERASE 1)		 4iwn TRNA
(CMO5U34)-METHYLTRAN
SFERASE
(Escherichia
coli) 		5 / 12 TYR A  39
GLY A  64
ASP A  89
SER A  91
ILE A 118
 GEK  A 301 (-4.7A)
GEK  A 301 (-3.6A)
GEK  A 301 (-2.8A)
GEK  A 301 (-4.6A)
GEK  A 301 (-3.7A)
 1.13A 5dpdB-4iwnA:
14.8		 5dpdB-4iwnA:
18.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ICX_E_SC2E1_1
(CETUXIMAB FAB LIGHT
CHAIN
MEDITOPE)		 4iwn TRNA
(CMO5U34)-METHYLTRAN
SFERASE
(Escherichia
coli) 		3 / 3 VAL A  54
GLN A  59
CYH A  83
 None
 0.78A 5icxA-4iwnA:
undetectable
5icxE-4iwnA:
undetectable		 5icxA-4iwnA:
21.31
5icxE-4iwnA:
8.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ICX_F_SC2F1_1
(CETUXIMAB FAB LIGHT
CHAIN
MEDITOPE)		 4iwn TRNA
(CMO5U34)-METHYLTRAN
SFERASE
(Escherichia
coli) 		3 / 3 VAL A  54
GLN A  59
CYH A  83
 None
 0.85A 5icxC-4iwnA:
undetectable
5icxF-4iwnA:
undetectable		 5icxC-4iwnA:
21.31
5icxF-4iwnA:
8.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5KB6_A_ADNA401_1
(ADENOSINE KINASE)		 4iwn TRNA
(CMO5U34)-METHYLTRAN
SFERASE
(Escherichia
coli) 		5 / 12 THR A 134
ALA A  69
GLY A  68
ALA A  70
ILE A  43
 GEK  A 301 ( 3.8A)
GEK  A 301 (-3.6A)
None
GEK  A 301 ( 4.1A)
None
 0.90A 5kb6A-4iwnA:
3.8		 5kb6A-4iwnA:
20.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5UBB_A_SAMA301_0
(ALPHA N-TERMINAL
PROTEIN
METHYLTRANSFERASE 1B)		 4iwn TRNA
(CMO5U34)-METHYLTRAN
SFERASE
(Escherichia
coli) 		5 / 12 VAL A 173
SER A 237
LEU A 228
VAL A 211
HIS A 214
 None
 0.92A 5ubbA-4iwnA:
17.0		 5ubbA-4iwnA:
20.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5UUN_A_ACTA310_0
(GLUTATHIONE
S-TRANSFERASE-LIKE
PROTEIN)		 4iwn TRNA
(CMO5U34)-METHYLTRAN
SFERASE
(Escherichia
coli) 		3 / 3 GLU A  96
HIS A 100
ARG A  99
 None
 0.97A 5uunA-4iwnA:
undetectable		 5uunA-4iwnA:
21.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5X23_A_LSNA503_1
(CYTOCHROME P450 2C9)		 4iwn TRNA
(CMO5U34)-METHYLTRAN
SFERASE
(Escherichia
coli) 		4 / 5 PRO A  56
GLY A  57
THR A  58
ASN A  82
 None
 1.07A 5x23A-4iwnA:
undetectable		 5x23A-4iwnA:
18.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5X24_A_LSNA503_1
(CYTOCHROME P450 2C9)		 4iwn TRNA
(CMO5U34)-METHYLTRAN
SFERASE
(Escherichia
coli) 		4 / 6 PRO A  56
GLY A  57
THR A  58
ASN A  82
 None
 1.00A 5x24A-4iwnA:
undetectable		 5x24A-4iwnA:
19.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XXI_A_LSNA502_1
(CYTOCHROME P450 2C9)		 4iwn TRNA
(CMO5U34)-METHYLTRAN
SFERASE
(Escherichia
coli) 		4 / 6 PRO A  56
GLY A  57
THR A  58
ASN A  82
 None
 1.08A 5xxiA-4iwnA:
undetectable		 5xxiA-4iwnA:
19.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XXI_A_LSNA502_1
(CYTOCHROME P450 2C9)		 4iwn TRNA
(CMO5U34)-METHYLTRAN
SFERASE
(Escherichia
coli) 		4 / 6 PRO A  56
GLY A  57
THR A  58
LYS A  84
 None
 1.08A 5xxiA-4iwnA:
undetectable		 5xxiA-4iwnA:
19.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6FGC_A_ACTA811_0
(GEPHYRIN)		 4iwn TRNA
(CMO5U34)-METHYLTRAN
SFERASE
(Escherichia
coli) 		3 / 3 LEU A 146
LEU A 138
ARG A 119
 None
None
GEK  A 301 ( 3.6A)
 0.70A 6fgcA-4iwnA:
undetectable		 6fgcA-4iwnA:
20.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6FGD_A_ACTA810_0
(GEPHYRIN)		 4iwn TRNA
(CMO5U34)-METHYLTRAN
SFERASE
(Escherichia
coli) 		3 / 3 LEU A 146
LEU A 138
ARG A 119
 None
None
GEK  A 301 ( 3.6A)
 0.68A 6fgdA-4iwnA:
2.4		 6fgdA-4iwnA:
20.95